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Benzo[b]thiophene-2-carboxamide, 3-chloro-N-(2,3-dihydrobenzo[1,4]dioxin-6-yl)-
SpectraBase Compound ID 7NAa7sgbqzb
InChI InChI=1S/C17H12ClNO3S/c18-15-11-3-1-2-4-14(11)23-16(15)17(20)19-10-5-6-12-13(9-10)22-8-7-21-12/h1-6,9H,7-8H2,(H,19,20)
InChIKey NXFCDYWICPAHHD-UHFFFAOYSA-N
Mol Weight 345.8 g/mol
Molecular Formula C17H12ClNO3S
Exact Mass 345.022642 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EXOck3Nkg0B
Name Benzo[B]thiophene-2-carboxamide, 3-chloro-N-(2,3-dihydrobenzo[1,4]dioxin-6-yl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.022642121 u
Formula C17H12ClNO3S
InChI InChI=1S/C17H12ClNO3S/c18-15-11-3-1-2-4-14(11)23-16(15)17(20)19-10-5-6-12-13(9-10)22-8-7-21-12/h1-6,9H,7-8H2,(H,19,20)
InChIKey NXFCDYWICPAHHD-UHFFFAOYSA-N
Molecular Weight 345.800 g/mol
SMILES C12=CC(=CC=C2OCCO1)NC(=O)C=1SC2=CC=CC=C2C1Cl